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Substance Name: Allylamine, N,N-bis(2-chloroethyl)-2-chloro-, hydrochloride
RN: 63905-37-3
InChIKey: FTCYKZUJBNQKIH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C7-H12-Cl3-N.Cl-H

Molecular Weight

  • 252.999
 
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Names and Synonyms

Synonym

  • 2-Chloroallyl-bis(2-chloroethyl)amine hydrochloride

Systematic Name

  • Allylamine, N,N-bis(2-chloroethyl)-2-chloro-, hydrochloride

Registry Numbers

CAS Registry Number

  • 63905-37-3

System Generated Number

  • 0063905373

Molecular Formulas

Molecular Formula

  • C7-H12-Cl3-N.Cl-H

Molecular Formula Fragments

  • C7-H12-Cl3-N
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C7H12Cl3N.ClH/c1-7(10)6-11(4-2-8)5-3-9;/h1-6H2;1H

InChIKey

FTCYKZUJBNQKIH-UHFFFAOYSA-N

Smiles

[NH+](CC(=C)Cl)(CCCl)CCCl.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 19mg/kg (19mg/kg)   Cancer Vol. 2, Pg. 1075, 1949.